Vitas-M small molecule compound
17-hydroxy-3,20-dioxopregn-4-en-21-yl 4-oxo-4-[(2-phenylethyl)amino]butanoate
Catalog ID
STL537834
SMILES O=C(OCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C)CCC(=O)NCCc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C33H43NO6 MW 549.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H43NO6/c1-31-16-12-24(35)20-23(31)8-9-25-26(31)13-17-32(2)27(25)14-18-33(32,39)28(36)21-40-30(38)11-10-29(37)34-19-15-22-6-4-3-5-7-22/h3-7,20,25-27,39H,8-19,21H2,1-2H3,(H,34,37)/t25-,26+,27+,31+,32+,33+/m1/s1InChIKey
SQZLURXSKWOJNM-MXCDKWNYSA-NSynonyms
1029873-19-5(2((8~(R)9~(S)10~(R)13~(S)14~(S)17~(R))17hydroxy1013dimethyl3oxo267891112141516decahydro1~(H)cyclopenta(a)phenanthren17yl)2oxoethyl)4oxo4(2phenylethylamino)butanoate
1029873195
16403545
17hydroxy320dioxopregn4en21yl4oxo4((2phenylethyl)amino)butanoate
2((8R9S10R13S14S17R)17hydroxy1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)2oxoethyl4oxo4(phenethylamino)butanoate
InChI=1SC33H43NO6c131161224(35)2023(31)892526(31)131732(2)27(25)141833(3239)28(36)214030(38)111029(37)341915226435722h3720252739H81921H212H3(H3437)t2526+27+31+32+33+m1s1
MFCD06496024
O=C(OCC(=O)(C@@)1(O)CC(C@@H)2(C@)1(C)CC(C@H)1(C@H)2CCC2=CC(=O)CC(C@)12C)CCC(=O)NCCc1ccccc1
ZINC000070698874
ZINC70698874
Check stock
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Check stock on Vitas-MAvailable files
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